SCHEMBL15280862

SCHEMBL15280862

CC(C)(C)C[C@H]1O[C@@H](n2cnc3c(=O)[nH]c(N)nc32)CC1OP(O)(O)=S

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.55
FUT5 Q11128 1/20 0.47
HPRT1 P00492 2/20 0.47
P2RY2 P41231 1/20 0.47
P2RY4 P51582 1/20 0.47
P2RY6 Q15077 1/20 0.47
NT5E P21589 1/20 0.46
HINT1 P49773 1/20 0.44
P2RY1 P47900 1/20 0.44
KRAS P01116 1/20 0.43
TGM2 P21980 1/20 0.43
KDM4E B2RXH2 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16587303 0.94 POLB (0.57) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL15280813 0.94 POLB (0.57) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL18057134 0.92 POLB (0.54) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL19887006 0.92 POLB (0.52) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL15280795 0.92 POLB (0.54) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL24784387 0.92 POLB (0.54) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL18057132 0.92 POLB (0.52) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL19884487 0.91 POLB (0.56) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL15304602 0.91 POLB (0.56) POLBFUT5HPRT1P2RY2P2RY4
SCHEMBL15329274 0.90 POLB (0.57) POLBFUT5HPRT1P2RY2P2RY4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8987226-B2 Modified single-stranded polynucleotides DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-03-24 US disclosed
US-20130253038-A1 Modified Single-Stranded Polynucleotide DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-09-26 US disclosed